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8-Methoxyobliquin

View entire compound with spectra: 1 FTIR

8-Methoxyobliquin
SpectraBase Compound ID 3N1pdfKBzyZ
InChI InChI=1S/C15H14O5/c1-8(2)11-7-18-14-10(19-11)6-9-4-5-12(16)20-13(9)15(14)17-3/h4-6,11H,1,7H2,2-3H3/t11-/m1/s1
InChIKey UKSGFFQLAZFFBP-LLVKDONJSA-N
Mol Weight 274.27 g/mol
Molecular Formula C15H14O5
Exact Mass 274.084124 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J5etMujoTQz
Name 8-Methoxyobliquin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.084123546 u
Formula C15H14O5
InChI InChI=1S/C15H14O5/c1-8(2)11-7-18-14-10(19-11)6-9-4-5-12(16)20-13(9)15(14)17-3/h4-6,11H,1,7H2,2-3H3/t11-/m1/s1
InChIKey UKSGFFQLAZFFBP-LLVKDONJSA-N
SMILES C12=C(C(=C3C(=C2)C=CC(O3)=O)OC)OC[C@@](O1)(C(C)=C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.815389